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Return to study ST000691 main page
Analysis: Reversed phase NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
4-METHYL-2-OXOPENTANOATE
Ketoleucine
ME192857
70
-
4.805
130.0631
CITRIC ACID
Citric acid
ME192862
311
-
1.003
192.027
HIPPURIC ACID
Hippuric acid
ME192874
464
-
4.8
179.0581
GLYCOLIC ACID
Glycolic acid
ME192873
757
-
0.678
152.0333
PHENYLACETIC ACID (M+HCOO)
Phenylacetic acid
ME192881
999
-
3.792
182.0578
URIC ACID
Uric acid
ME192885
1175
-
0.995
168.0283
XANTHINE
Xanthine
ME192888
1188
-
1.318
152.0335
STEARIC ACID
Stearic acid
ME192882
5281
-
23.169
284.2715
FRUCTOSE (M-H)
Fructose
ME192870
5984
-
0.64
180.0633
URIDINE (M-H)
Uridine
ME192886
6029
-
1.337
244.0699
EDTA
Edetic acid
ME192866
6049
-
0.656
292.0911
EDTA - 0.65225005
Edetic acid
ME192867
6049
-
0.652
274.0805
EDTA - 0.68095005
Edetic acid
ME192868
6049
-
0.681
292.0911
TYROSINE
Tyrosine
ME192884
6057
-
1.319
181.0736
TRYPTOPHAN
Tryptophan
ME192883
6305
-
3.599
204.0897
MYRISTIC ACID
Myristic acid
ME192880
11005
-
22.428
228.209
2-HYDROXY-BUTANOIC ACID
2-Hydroxybutyric acid
ME192855
11266
-
0.664
86.0366
URSODIOL-2 WATER
Ursodeoxycholic acid
ME192887
31401
-
21.694
392.2927
GLUCARIC ACID
Glucaric acid
ME192871
33037
-
0.663
192.0271
4-HYDROXY-L-PHENYLGLYCINE
4-Hydroxyphenylglycine
ME192856
36143
-
0.668
334.0723
DEOXYURIDINE MONOPHOSPHATE (DUMP)
dUMP
ME192865
65063
-
0.967
308.0412
IMIDAZOLEACETIC ACID
Imidazoleacetic acid
ME192876
96215
-
0.647
288.0598
HYPOTAURINE
Hypotaurine
ME192875
107812
-
0.621
218.0378
CHOLATE
Cholic acid
ME192859
221493
-
20.386
408.2877
DEOXYCHOLIC ACID
Deoxycholic acid
ME192864
222528
-
21.621
392.2922
CORTISONE (M+HCOO)
Cortisone
ME192863
222786
-
13.392
406.1991
GLYCERIC ACID (-H2O)
Glyceric acid
ME192872
439194
-
0.672
88.0163
L-MIMOSINE
Mimosine
ME192878
440473
-
0.686
145.0369
ACONITIC ACID
cis-Aconitic acid
ME192858
444212
-
1.147
174.0165
(4Z,7Z,10Z,13Z,16Z,19Z)-4,7,10,13,1 6,19-DOCOSAHEX...
DHA
ME192854
445580
-
22.669
328.2406
CIS-9-PALMITOLEIC ACID
Palmitoleic acid
ME192861
445638
-
22.559
254.2248
ELAIDIC ACID
Elaidic acid
ME192869
637517
-
22.911
282.2563
L-(+)-ARABINOSE
Lyxose
ME192877
641630
-
0.662
150.0525
LINOLEIC ACID
Linoleic acid
ME192879
5280450
-
22.701
280.2405
CIS-7,10,13,16-DOCOSATETRAENOIC ACID
Adrenic acid
ME192860
5497181
-
22.944
332.2723
Analysis: Reversed phase POSITIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
4-METHYL-2-OXOPENTANOATE (2M+H)
Ketoleucine
ME192890
70
-
4.851
260.1242
HIPPURIC ACID
Hippuric acid
ME192900
464
-
4.805
179.0582
CREATINE
Creatine
ME192895
586
-
0.737
131.0693
3-DEHYDROXYCARNITINE
3-Dehydroxycarnitine
ME192889
725
-
0.671
145.1096
URIC ACID
Uric acid
ME192917
1175
-
0.997
168.0285
CAFFEINE
Caffeine
ME192892
2519
-
5.869
194.0798
CAFFEINE + 5.870583
Caffeine
ME192893
2519
-
5.871
216.0621
SALICYLAMIDE
Salicylamide
ME192913
5147
-
5.35
137.0475
THEOBROMINE
Theobromine
ME192914
5429
-
3.452
180.0645
EDTA
Edetic acid
ME192899
6049
-
0.789
292.0909
TYROSINE
Tyrosine
ME192916
6057
-
1.321
181.0738
METHIONINE
Methionine
ME192905
6137
-
0.981
149.0511
VALINE
Valine
ME192918
6287
-
0.882
117.0791
TRYPTOPHAN
Tryptophan
ME192915
6305
-
3.603
204.0899
ISOLEUCINE
Isoleucine
ME192901
6306
-
1.561
131.0946
PANTOTHENIC ACID
Pantothenic acid
ME192910
6613
-
3.28
219.1104
DIOCTYL PHTHALATE + 23.07955
Dioctyl phthalate
ME192897
8346
-
23.08
412.2596
DIOCTYL PHTHALATE + 23.08
Dioctyl phthalate
ME192898
8346
-
23.08
390.2783
DIOCTYL PHTHALATE (2M+Na)
Dioctyl phthalate
ME192896
8346
-
23.08
802.5368
4-QUINOLINECARBOXYLIC ACID
4-Quinolinecarboxylic acid
ME192891
10243
-
4.961
173.0479
L-CARNITINE
Carnitine
ME192903
10917
-
0.703
161.105
L-CARNITINE + 0.66735
Carnitine
ME192904
10917
-
0.667
143.0946
N-CYCLOHEXYLFORMAMIDE
N-Cyclohexylformamide
ME192907
13017
-
7.936
127.0991
O-ACETYLCARNITINE + 0.92200005
CAR 2:0
ME192909
18230
-
0.922
203.1158
O-ACETYLCARNITINE (-H2O)
CAR 2:0
ME192908
18230
-
0.903
185.105
PROLINE
Proline
ME192911
145742
-
0.683
115.0635
KYNURENINE
Kynurenine
ME192902
161166
-
2.191
208.0845
CORTISONE (M+Na)
Cortisone
ME192894
222786
-
13.4
382.1775
RETINOIC ACID
Retinoic acid
ME192912
444795
-
22.484
300.2073
METHYL JASMONATE (M+Na)
Methyl jasmonate
ME192906
5281929
-
16.09
246.1225
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